N-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide

C15H15FN4O2 — CID 86790913

IUPACN-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide
SMILESCC(CNC(=O)c1c[nH]n2ccnc12)Oc1ccc(F)cc1
InChIInChI=1S/C15H15FN4O2/c1-10(22-12-4-2-11(16)3-5-12)8-18-15(21)13-9-19-20-7-6-17-14(13)20/h2-7,9-10,19H,8H2,1H3,(H,18,21)
InChIKeyBVPCBUKFIZRGPC-UHFFFAOYSA-N
MW302.31 g/mol
LogP2.00
Rot. Bonds5

About N-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide

N-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide (PubChem CID 86790913) has the molecular formula C15H15FN4O2 and a molecular weight of 302.31 g/mol. Its IUPAC name is N-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide
PubChem CID86790913
Molecular FormulaC15H15FN4O2
Molecular Weight302.31 g/mol
Exact Mass302.12
IUPAC NameN-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide
SMILESCC(CNC(=O)c1c[nH]n2ccnc12)Oc1ccc(F)cc1
InChIInChI=1S/C15H15FN4O2/c1-10(22-12-4-2-11(16)3-5-12)8-18-15(21)13-9-19-20-7-6-17-14(13)20/h2-7,9-10,19H,8H2,1H3,(H,18,21)
InChIKeyBVPCBUKFIZRGPC-UHFFFAOYSA-N
XLogP2.00
TPSA71.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.31
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide?
The IUPAC name of N-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide (CID 86790913) is N-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide.
What is the SMILES notation for N-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide?
The canonical SMILES for N-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide is CC(CNC(=O)c1c[nH]n2ccnc12)Oc1ccc(F)cc1.
What is the InChIKey of N-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide?
The InChIKey is BVPCBUKFIZRGPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN4O2/c1-10(22-12-4-2-11(16)3-5-12)8-18-15(21)13-9-19-20-7-6-17-14(13)20/h2-7,9-10,19H,8H2,1H3,(H,18,21).
What are the key properties of N-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide?
N-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide has a molecular weight of 302.31 g/mol, XLogP of 2.00, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenoxy)propyl]-5H-imidazo[1,2-b]pyrazole-7-carboxamide is sourced from PubChem (CID 86790913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).